(Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine

C24H21N3O — CID 5482484

IUPAC(Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine
SMILESc1ccc(/C(Cn2ccnc2)=N/OCc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C24H21N3O/c1-3-7-21(8-4-1)22-13-11-20(12-14-22)18-28-26-24(17-27-16-15-25-19-27)23-9-5-2-6-10-23/h1-16,19H,17-18H2/b26-24+
InChIKeyVXXUNDFYLYWQKH-SHHOIMCASA-N
MW367.45 g/mol
LogP5.17
Rot. Bonds7

About (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine

(Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine (PubChem CID 5482484) has the molecular formula C24H21N3O and a molecular weight of 367.45 g/mol. Its IUPAC name is (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine.

Molecular Properties

Compound Name(Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine
PubChem CID5482484
Molecular FormulaC24H21N3O
Molecular Weight367.45 g/mol
Exact Mass367.17
IUPAC Name(Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine
SMILESc1ccc(/C(Cn2ccnc2)=N/OCc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C24H21N3O/c1-3-7-21(8-4-1)22-13-11-20(12-14-22)18-28-26-24(17-27-16-15-25-19-27)23-9-5-2-6-10-23/h1-16,19H,17-18H2/b26-24+
InChIKeyVXXUNDFYLYWQKH-SHHOIMCASA-N
XLogP5.17
TPSA39.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.45
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine?
The IUPAC name of (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine (CID 5482484) is (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine.
What is the SMILES notation for (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine?
The canonical SMILES for (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine is c1ccc(/C(Cn2ccnc2)=N/OCc2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine?
The InChIKey is VXXUNDFYLYWQKH-SHHOIMCASA-N. The full InChI is InChI=1S/C24H21N3O/c1-3-7-21(8-4-1)22-13-11-20(12-14-22)18-28-26-24(17-27-16-15-25-19-27)23-9-5-2-6-10-23/h1-16,19H,17-18H2/b26-24+.
What are the key properties of (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine?
(Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine has a molecular weight of 367.45 g/mol, XLogP of 5.17, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine is sourced from PubChem (CID 5482484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).